prop-2-enyl 2,4-dimethoxy-5-nitro-benzoate

Systemtic Name: prop-2-enyl 2,4-dimethoxy-5-nitro-benzoate Openeye Name: allyl 2,4-dimethoxy-5-nitro-benzoate CAS Name: 2,4-dimethoxy-5-nitrobenzoic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 2,4-dimethoxy-5-nitrobenzoate Traditional Name: 2,4-dimethoxy-5-nitro-benzoic acid allyl ester Formula: C12H13NO6 MolecularWeight: 267.23472

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)OCC=C)[N+](=O)[O-])OC

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)OCC=C)[N+](=O)[O-])OC

InChI

InChI=1S/C12H13NO6/c1-4-5-19-12(14)8-6-9(13(15)16)11(18-3)7-10(8)17-2/h4,6-7H,1,5H2,2-3H3